1-[6-oxidanylidene-6-[4-(phenylmethyl)sulfonylpiperazin-1-yl]hexyl]urea

Systemtic Name: 1-[6-oxidanylidene-6-[4-(phenylmethyl)sulfonylpiperazin-1-yl]hexyl]urea Openeye Name: [6-(4-benzylsulfonylpiperazin-1-yl)-6-oxo-hexyl]urea CAS Name: [6-oxo-6-[4-(phenylmethyl)sulfonyl-1-piperazinyl]hexyl]urea IUPAC Name: [6-(4-benzylsulfonylpiperazin-1-yl)-6-oxohexyl]urea Traditional Name: [6-(4-benzylsulfonylpiperazino)-6-keto-hexyl]urea Formula: C18H28N4O4S MolecularWeight: 396.50432

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCCCNC(=O)N)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1C(=O)CCCCCNC(=O)N)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C18H28N4O4S/c19-18(24)20-10-6-2-5-9-17(23)21-11-13-22(14-12-21)27(25,26)15-16-7-3-1-4-8-16/h1,3-4,7-8H,2,5-6,9-15H2,(H3,19,20,24)